N-{2-[(azepan-1-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-{2-[(azepan-1-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}-3,4,5-trimethoxybenzamide
N-{2-[(azepan-1-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}-3,4,5-trimethoxybenzamide
Compound characteristics
| Compound ID: | D332-0096 |
| Compound Name: | N-{2-[(azepan-1-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}-3,4,5-trimethoxybenzamide |
| Molecular Weight: | 480.61 |
| Molecular Formula: | C27 H36 N4 O4 |
| Smiles: | CCCn1c2ccc(cc2nc1CN1CCCCCC1)NC(c1cc(c(c(c1)OC)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6779 |
| logD: | 4.1099 |
| logSw: | -4.3273 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.526 |
| InChI Key: | IOAAGMODFQBWHJ-UHFFFAOYSA-N |